Go to resource

3-Rha-7-Rha Kaempferol (NMR)

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS001024

Dataset description:

This MassBank record with Accession MSBNK-BS-BS001024 contains the MS mass spectrum of 3-Rha-7-Rha Kaempferol (NMR) with the InChIkey PUPKKEQDLNREIM-QNSQPKOQSA-N.

Source: 3-Rha-7-Rha Kaempferol (NMR)

Chemical Info

molecular Image

InChI	InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9-,10-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1
SMILES	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)O[C@H]4[C@@H]([C@@H]([C@H]([C@@H](O4)C)O)O)O)C5=CC=C(C=C5)O)O)O)O)O
InChI Key	PUPKKEQDLNREIM-QNSQPKOQSA-N
Molecular Formula	C27H30O14
Exact Mass	578.164 g/mol

There are no views created for this resource yet.

Additional Information

Field	Value
Data last updated	January 11, 2024
Metadata last updated	January 11, 2024
Created	January 11, 2024
Format	HTML
License	Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0)
Id	b40e64e5-0f63-42f9-86da-af0244c784d7
Package id	msbnk-bs-bs001024
Resource type	HTML
State	active